Geometry & MOs

Info

ID:	319212
PubChem CID:	126655338
Reduced:	ON3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	269.152812
ΔH_f, kcal/mol:	0.02
Dipole, Da:	3.6
IP(EA), eV:	-8.41(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-benzylpyrazol-3-yl)piperidine-3-carbaldehyde

Drug info:

PubChemData

Smile

CC1CC(CC(N1C2=NN(C=C2)CC3=CC=CC=C3)C)O

DOS

IR

Vibrations